| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:56:36 UTC |
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| Update Date | 2025-03-25 00:52:23 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02193470 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H20O4 |
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| Molecular Mass | 228.1362 |
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| SMILES | CCCCCC(=O)OCCC1CCC(=O)O1 |
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| InChI Key | QTMNTOXCOFUSFD-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | fatty acyls |
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| Subclass | fatty acid esters |
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| Direct Parent | fatty acid esters |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acid estersdicarboxylic acids and derivativesgamma butyrolactoneshydrocarbon derivativesorganic oxidesoxacyclic compoundstetrahydrofurans |
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| Substituents | carbonyl grouptetrahydrofurancarboxylic acid derivativegamma butyrolactonelactoneoxacyclefatty acid esterorganic oxideorganic oxygen compoundcarboxylic acid esteraliphatic heteromonocyclic compounddicarboxylic acid or derivativeshydrocarbon derivativeorganoheterocyclic compoundorganooxygen compound |
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